About [(2R)-4-methylidenepyrrolidin-2-yl]methanol
[(2R)-4-methylidenepyrrolidin-2-yl]methanol (PubChem CID 55287072) has the molecular formula C6H11NO
and a molecular weight of 113.16 g/mol. Its IUPAC name is [(2R)-4-methylidenepyrrolidin-2-yl]methanol.
Molecular Properties
| Compound Name | [(2R)-4-methylidenepyrrolidin-2-yl]methanol |
| PubChem CID | 55287072 |
| Molecular Formula | C6H11NO |
| Molecular Weight | 113.16 g/mol |
| Exact Mass | 113.08 |
| IUPAC Name | [(2R)-4-methylidenepyrrolidin-2-yl]methanol |
| SMILES | C=C1CN[C@@H](CO)C1 |
| InChI | InChI=1S/C6H11NO/c1-5-2-6(4-8)7-3-5/h6-8H,1-4H2/t6-/m1/s1 |
| InChIKey | WLPBHSFDRNAUCU-ZCFIWIBFSA-N |
| XLogP | -0.10 |
| TPSA | 32.26 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 8 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 113.16 |
| LogP ≤ 5 | -0.10 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of [(2R)-4-methylidenepyrrolidin-2-yl]methanol?
The IUPAC name of [(2R)-4-methylidenepyrrolidin-2-yl]methanol (CID 55287072) is [(2R)-4-methylidenepyrrolidin-2-yl]methanol.
What is the SMILES notation for [(2R)-4-methylidenepyrrolidin-2-yl]methanol?
The canonical SMILES for [(2R)-4-methylidenepyrrolidin-2-yl]methanol is C=C1CN[C@@H](CO)C1.
What is the InChIKey of [(2R)-4-methylidenepyrrolidin-2-yl]methanol?
The InChIKey is WLPBHSFDRNAUCU-ZCFIWIBFSA-N. The full InChI is InChI=1S/C6H11NO/c1-5-2-6(4-8)7-3-5/h6-8H,1-4H2/t6-/m1/s1.
What are the key properties of [(2R)-4-methylidenepyrrolidin-2-yl]methanol?
[(2R)-4-methylidenepyrrolidin-2-yl]methanol has a molecular weight of 113.16 g/mol, XLogP of -0.10, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-methylidenepyrrolidin-2-yl]methanol is sourced from PubChem (CID 55287072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).